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PLS-近红外漫反射光谱法非破坏分析安乃近
引用本文:任玉林,李伟,郭晔,任玉秋,张璐,孙莹,陈博.PLS-近红外漫反射光谱法非破坏分析安乃近[J].吉林大学学报(理学版),1997(3).
作者姓名:任玉林  李伟  郭晔  任玉秋  张璐  孙莹  陈博
作者单位:吉林大学化学系!长春,130023(任玉林,李伟,郭晔),白城卫生学校!白城,137000(任玉秋),长春医学高等专科学校药学系!长春,130031(张璐,孙莹,陈博)
摘    要:比较了偏最小二乘(PLS)法在常规和一阶导数近红外漫反射光谱法分析安乃近的定量预测能力;讨论了校正集样品数和波长间隔对PLS预测的影响.在常规光谱法中,校正样品和预测样品的预测结果的相对标准误差分别为0.9891%和1.4630%.而在一阶导数光谱法中,校正样品和预测样品的预测结果的相对标准误差分别为0.1102%和1.0429%.

关 键 词:偏最小二乘法  近红外漫反射光谱法  安乃近  非破坏分析

Noninvasive Analysis of Analgini by PLS-Near-infrared Diffuse Reflectance Spectroscopy
Ren Yulin, Li Wei, Guo Ye.Noninvasive Analysis of Analgini by PLS-Near-infrared Diffuse Reflectance Spectroscopy[J].Journal of Jilin University: Sci Ed,1997(3).
Authors:Ren Yulin  Li Wei  Guo Ye
Abstract:The solid samples of analgini were analyzed noninvasively by means of conventional and first derivative near-infrared diffuse reflectance spectra. The quantitative prediction abilities of partial least squares methods in both cases were compared. The influence of the calibration samples and wavelengths on the Capacity of PLS are discussed. The relative standard errors of prediction for the calibration samples and prediction samples with conventional spectra are 0.9891% and 1. 463 0%,while those with derivative spectra are 0. 110 2% and 1. 042 9%, respectively.
Keywords:partial least squares method  near-infrared diffuse reflectance spectraum  analgini  noninvasive analysis
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